Skip to main content

Table 2 Predictive results using the SSB classifier for 6 different datasets.

From: A molecular structure matching approach to efficient identification of endogenous mammalian biochemical structures

Dataset Number of Compounds BioSM BioSMXpress
HMDB Compounds 2,329 88% 91%
Plant Metabolites 2,416 73% 72%
Drug Compounds 3,282 62% 58%
PubChem Compounds 46,203 35% 25%
Synthetic Compounds 374,509 33% 36%